ChemSpider 2D Image | N~2~-acetyl-N~5~-[N-(methylcarbamoyl)carbamimidoyl]-L-ornithyl-N-methyl-L-phenylalanyl-L-aspartic acid | C24H35N7O8

N2-acetyl-N5-[N-(methylcarbamoyl)carbamimidoyl]-L-ornithyl-N-methyl-L-phenylalanyl-L-aspartic acid

  • Molecular FormulaC24H35N7O8
  • Average mass549.577 Da
  • Monoisotopic mass549.255000 Da
  • ChemSpider ID25059113

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(E)-N2-Acetyl-N5-{amino[(methylcarbamoyl)amino]methylen}-L-ornithyl-N-methyl-L-phenylalanyl-L-asparaginsäure [German] [ACD/IUPAC Name]
(E)-N2-Acetyl-N5-{amino[(methylcarbamoyl)amino]methylene}-L-ornithyl-N-methyl-L-phenylalanyl-L-aspartic acid [ACD/IUPAC Name]
Acide (E)-N2-acétyl-N5-{amino[(méthylcarbamoyl)amino]méthylène}-L-ornithyl-N-méthyl-L-phénylalanyl-L-aspartique [French] [ACD/IUPAC Name]
L-Aspartic acid, (E)-N2-acetyl-N5-[amino[[(methylamino)carbonyl]amino]methylene]-L-ornithyl-N-methyl-L-phenylalanyl- [ACD/Index Name]
N2-acetyl-N5-[N-(methylcarbamoyl)carbamimidoyl]-L-ornithyl-N-methyl-L-phenylalanyl-L-aspartic acid
Tripeptide

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 8681 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.0 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 138.0±0.0 cm3
#H bond acceptors: 15
#H bond donors: 8
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 230 Å2
Polarizability: 54.7±0.0 10-24cm3
Surface Tension: 56.9±0.0 dyne/cm
Molar Volume: 396.5±0.0 cm3

Click to predict properties on the Chemicalize site


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